HRID101315

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID12503

(3-Bromopropyl)benzene

C9H11Br

结构：O=C1NCN(c2ccccc2)C12CCN(C1CCCCCCCCC1)CC2

HCID9842289

未命名化合物

PRODUCTS

生成物

HCID313

Hydrochloric Acid

ClH

结构：O=C1N(CCCc2ccccc2)CN(c2ccccc2)C12CCN(C1CCCCCCCCC1)CC2

HCID19347409

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a46a369e312244778fdad105e0ae7851
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH:2]1([N:12]2[CH2:13][CH2:14][C:15]3([C:16](=[O:26])[NH:17][CH2:18][N:19]3[c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[CH2:27][CH2:28]2)[CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11]1.[ClH:1].[c:29]1([CH2:35][CH2:36][CH2:37][Br:38])[cH:30][cH:31][cH:32][cH:33][cH:34]1>>[CH:2]1([N:12]2[CH2:13][CH2:14][C:15]3([C:16](=[O:26])[N:17]([CH2:37][CH2:36][CH2:35][c:29]4[cH:30][cH:31][cH:32][cH:33][cH:34]4)[CH2:18][N:19]3[c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[CH2:27][CH2:28]2)[CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11]1.[ClH:1]